| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
D |
337 |
84 |
22857 |
◊ |
A |
x-y+1,x,z-1/6 |
2_654 |
327 |
85 |
23059 |
3193.5 |
-29.0 |
0.071 |
18 |
22 |
0 |
0.836 |
2 |
|
C |
337 |
85 |
22453 |
◊ |
B |
x,y,z |
1_555 |
333 |
84 |
22974 |
3191.5 |
-29.8 |
0.057 |
20 |
22 |
0 |
0.836 |
| Average: |
3192.5 |
-29.4 |
0.064 |
19 |
22 |
0 |
0.836 |
| 2 |
3 |
|
B |
83 |
24 |
22974 |
◊ |
A |
x,y,z |
1_555 |
81 |
23 |
23059 |
752.3 |
-2.2 |
0.574 |
18 |
8 |
0 |
0.000 |
| 3 |
4 |
|
B |
67 |
19 |
22974 |
x |
B |
x-y,x-1,z-1/6 |
2_544 |
78 |
25 |
22974 |
679.9 |
-5.7 |
0.258 |
7 |
1 |
0 |
0.000 |
5 |
|
A |
79 |
25 |
23059 |
x |
A |
x-y,x-1,z-1/6 |
2_544 |
70 |
19 |
23059 |
665.4 |
-5.5 |
0.305 |
6 |
1 |
0 |
0.000 |
| Average: |
672.6 |
-5.6 |
0.281 |
7 |
1 |
0 |
0.000 |
| 4 |
6 |
|
C |
67 |
20 |
22453 |
◊ |
D |
-y+2,x-y,z-1/3 |
3_754 |
70 |
20 |
22857 |
581.3 |
-1.7 |
0.533 |
8 |
1 |
0 |
0.000 |
| 5 |
7 |
|
[GDP]A:601 |
28 |
1 |
549 |
f |
A |
x,y,z |
1_555 |
57 |
23 |
23059 |
384.7 |
-8.4 |
0.464 |
15 |
0 |
0 |
0.404 |
8 |
|
[GDP]B:601 |
28 |
1 |
550 |
f |
B |
x,y,z |
1_555 |
57 |
25 |
22974 |
383.7 |
-8.2 |
0.490 |
15 |
0 |
0 |
0.404 |
9 |
|
[GDP]C:601 |
28 |
1 |
554 |
f |
C |
x,y,z |
1_555 |
49 |
20 |
22453 |
360.8 |
-6.6 |
0.566 |
14 |
0 |
0 |
0.404 |
| Average: |
376.4 |
-7.7 |
0.507 |
15 |
0 |
0 |
0.404 |
| 6 |
10 |
|
D |
24 |
6 |
22857 |
◊ |
C |
x,y,z |
1_555 |
22 |
6 |
22453 |
180.7 |
-1.2 |
0.414 |
0 |
0 |
0 |
0.000 |
| 7 |
11 |
|
[GOL]B:602 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
22974 |
117.8 |
-0.2 |
0.569 |
2 |
0 |
0 |
0.016 |
| 8 |
12 |
|
[GOL]B:604 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
22974 |
110.2 |
0.3 |
0.639 |
3 |
0 |
0 |
0.014 |
| 9 |
13 |
|
[EDO]D:603 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
22857 |
101.4 |
2.7 |
0.470 |
4 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[EDO]A:602 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
17 |
8 |
23059 |
95.6 |
2.5 |
0.284 |
2 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[EDO]A:603 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
23059 |
94.4 |
2.9 |
0.497 |
3 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[GOL]B:605 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
22974 |
89.9 |
-0.0 |
0.592 |
2 |
0 |
0 |
0.013 |
| 13 |
17 |
|
[GOL]A:607 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
23059 |
85.3 |
1.0 |
0.779 |
2 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[EDO]C:602 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
22453 |
84.1 |
2.8 |
0.303 |
2 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[EDO]A:604 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
23059 |
83.8 |
2.2 |
0.266 |
2 |
0 |
0 |
0.000 |
| 16 |
20 |
|
[EDO]D:602 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
8 |
5 |
22857 |
82.2 |
2.1 |
0.299 |
5 |
0 |
0 |
0.002 |
| 17 |
21 |
|
[EDO]A:606 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
23059 |
79.3 |
2.7 |
0.920 |
1 |
0 |
0 |
0.000 |
| 18 |
22 |
|
[EDO]A:605 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
23059 |
77.2 |
1.5 |
0.726 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[EDO]D:601 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
22857 |
76.1 |
2.0 |
0.872 |
3 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[EDO]B:603 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
22974 |
74.9 |
2.7 |
0.317 |
1 |
0 |
0 |
0.000 |
| 21 |
25 |
|
A |
10 |
3 |
23059 |
f |
[EDO]A:604 |
x-y,x-1,z-1/6 |
2_544 |
3 |
1 |
184 |
53.6 |
1.3 |
0.249 |
3 |
0 |
0 |
0.002 |
| 22 |
26 |
|
B |
9 |
3 |
22974 |
◊ |
[GOL]B:605 |
x-y,x-1,z-1/6 |
2_544 |
3 |
1 |
217 |
50.1 |
-0.6 |
0.483 |
0 |
0 |
0 |
0.000 |
| 23 |
27 |
|
[EDO]D:603 |
2 |
1 |
183 |
f |
[EDO]D:602 |
x,y,z |
1_555 |
2 |
1 |
183 |
6.5 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
[EDO]A:604 |
1 |
1 |
184 |
f |
[EDO]A:602 |
x,y,z |
1_555 |
1 |
1 |
185 |
1.0 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
|